hydride;3-(9-phenylcarbazol-3-yl)-9-(4-phenylphenyl)carbazole

C42H29N2- — CID 163952243

IUPAChydride;3-(9-phenylcarbazol-3-yl)-9-(4-phenylphenyl)carbazole
SMILES[H-].c1ccc(-c2ccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)ccc43)cc2)cc1
InChIInChI=1S/C42H28N2.H/c1-3-11-29(12-4-1)30-19-23-34(24-20-30)44-40-18-10-8-16-36(40)38-28-32(22-26-42(38)44)31-21-25-41-37(27-31)35-15-7-9-17-39(35)43(41)33-13-5-2-6-14-33;/h1-28H;/q;-1
InChIKeySAINIHRDZJYEQP-UHFFFAOYSA-N
MW561.71 g/mol
LogP11.33
Rot. Bonds4

About hydride;3-(9-phenylcarbazol-3-yl)-9-(4-phenylphenyl)carbazole

hydride;3-(9-phenylcarbazol-3-yl)-9-(4-phenylphenyl)carbazole (PubChem CID 163952243) has the molecular formula C42H29N2- and a molecular weight of 561.71 g/mol. Its IUPAC name is hydride;3-(9-phenylcarbazol-3-yl)-9-(4-phenylphenyl)carbazole.

Molecular Properties

Compound Namehydride;3-(9-phenylcarbazol-3-yl)-9-(4-phenylphenyl)carbazole
PubChem CID163952243
Molecular FormulaC42H29N2-
Molecular Weight561.71 g/mol
Exact Mass561.23
IUPAC Namehydride;3-(9-phenylcarbazol-3-yl)-9-(4-phenylphenyl)carbazole
SMILES[H-].c1ccc(-c2ccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)ccc43)cc2)cc1
InChIInChI=1S/C42H28N2.H/c1-3-11-29(12-4-1)30-19-23-34(24-20-30)44-40-18-10-8-16-36(40)38-28-32(22-26-42(38)44)31-21-25-41-37(27-31)35-15-7-9-17-39(35)43(41)33-13-5-2-6-14-33;/h1-28H;/q;-1
InChIKeySAINIHRDZJYEQP-UHFFFAOYSA-N
XLogP11.33
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms44
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500561.71
LogP ≤ 511.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

9-phenyl-3-[4-[3-(4-phenylphenyl)carbazol-9-yl]phenyl]carbazole
CID 126682013
3-(9-phenylcarbazol-3-yl)-9-(4-phenylphenyl)carbazole;9-phenyl-3-(9-phenylcarbazol-3-yl)carbazole
CID 158377312
3-(9-phenylcarbazol-3-yl)-9-[4-(4-phenylphenyl)phenyl]carbazole
CID 118268216
3-(6,9-diphenylcarbazol-3-yl)-6,9-diphenylcarbazole;3,9-diphenyl-6-(9-phenylcarbazol-3-yl)carbazole;9-(4-phenylphenyl)-3-[9-(4-phenylphenyl)carbazol-3-yl]carbazole
CID 158667860
3-(4-carbazol-9-ylphenyl)-9-phenylcarbazole
CID 20685483
3-[9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazol-3-yl]-9-phenylcarbazole
CID 90085403
3-(9-phenylcarbazol-3-yl)-9-[4-[4-[3-[3-(3-phenylphenyl)phenyl]phenyl]phenyl]phenyl]carbazole
CID 154590601
6-(4-carbazol-9-ylphenyl)-2,9-diphenylcarbazole
CID 126682018
3-(9-phenylcarbazol-3-yl)-9-[3-(4-phenylphenyl)phenyl]carbazole;3-(9-phenylcarbazol-3-yl)-9-[4-(4-phenylphenyl)phenyl]carbazole
CID 161279377
3-[9-(3-phenylphenyl)carbazol-3-yl]-9-[3-(4-phenylphenyl)phenyl]carbazole;3-[9-(3-phenylphenyl)carbazol-3-yl]-9-[4-(4-phenylphenyl)phenyl]carbazole
CID 161418420
3,6-diphenyl-9-[4-(9-phenylcarbazol-2-yl)phenyl]carbazole
CID 118084405
9-(3-phenylphenyl)-3-[9-(4-phenylphenyl)carbazol-3-yl]carbazole
CID 118014168

Frequently Asked Questions

What is the IUPAC name of hydride;3-(9-phenylcarbazol-3-yl)-9-(4-phenylphenyl)carbazole?
The IUPAC name of hydride;3-(9-phenylcarbazol-3-yl)-9-(4-phenylphenyl)carbazole (CID 163952243) is hydride;3-(9-phenylcarbazol-3-yl)-9-(4-phenylphenyl)carbazole.
What is the SMILES notation for hydride;3-(9-phenylcarbazol-3-yl)-9-(4-phenylphenyl)carbazole?
The canonical SMILES for hydride;3-(9-phenylcarbazol-3-yl)-9-(4-phenylphenyl)carbazole is [H-].c1ccc(-c2ccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)ccc43)cc2)cc1.
What is the InChIKey of hydride;3-(9-phenylcarbazol-3-yl)-9-(4-phenylphenyl)carbazole?
The InChIKey is SAINIHRDZJYEQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C42H28N2.H/c1-3-11-29(12-4-1)30-19-23-34(24-20-30)44-40-18-10-8-16-36(40)38-28-32(22-26-42(38)44)31-21-25-41-37(27-31)35-15-7-9-17-39(35)43(41)33-13-5-2-6-14-33;/h1-28H;/q;-1.
What are the key properties of hydride;3-(9-phenylcarbazol-3-yl)-9-(4-phenylphenyl)carbazole?
hydride;3-(9-phenylcarbazol-3-yl)-9-(4-phenylphenyl)carbazole has a molecular weight of 561.71 g/mol, XLogP of 11.33, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for hydride;3-(9-phenylcarbazol-3-yl)-9-(4-phenylphenyl)carbazole is sourced from PubChem (CID 163952243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).